3-chloro-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-[3-(methylsulfanyl)phenyl]carbamimidoyl}benzamide
Chemical Structure Depiction of
3-chloro-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-[3-(methylsulfanyl)phenyl]carbamimidoyl}benzamide
3-chloro-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-[3-(methylsulfanyl)phenyl]carbamimidoyl}benzamide
Compound characteristics
| Compound ID: | F341-0741 |
| Compound Name: | 3-chloro-N-{N-[2-(1-ethyl-3,5-dimethyl-1H-pyrazol-4-yl)ethyl]-N'-[3-(methylsulfanyl)phenyl]carbamimidoyl}benzamide |
| Molecular Weight: | 470.04 |
| Molecular Formula: | C24 H28 Cl N5 O S |
| Smiles: | CCn1c(C)c(CCN/C(NC(c2cccc(c2)[Cl])=O)=N/c2cccc(c2)SC)c(C)n1 |
| Stereo: | ACHIRAL |
| logP: | 4.5197 |
| logD: | 4.5077 |
| logSw: | -4.617 |
| Hydrogen bond acceptors count: | 5 |
| Hydrogen bond donors count: | 2 |
| Polar surface area: | 55.971 |
| InChI Key: | ZHFZYWBFAJZAIF-UHFFFAOYSA-N |